Geometry & MOs

Info

ID:	145513
PubChem CID:	53536727
Reduced:	FN2O4C15H17 (1)
Stoich.:	AB2C4D15E17 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-198.43
Dipole, Da:	4.54
IP(EA), eV:	-9.7(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-[3-(2-oxopyrrolidin-1-yl)propyl]urea

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)COC(=O)C2=CC=CC=C2F)C(=O)N

DOS

IR

Vibrations